methyl[(2-methylcyclopropyl)methyl]amine

• ChemBase ID: 272850
• Molecular Formular: C6H13N
• Molecular Mass: 99.17412
• Monoisotopic Mass: 99.10479942
• SMILES: C1C(C1C)CNC
• Canonical SMILES: CNCC1CC1C
• InChI: InChI=1S/C6H13N/c1-5-3-6(5)4-7-2/h5-7H,3-4H2,1-2H3
• InChIKey: VMVQWPJUETYXCM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl[(2-methylcyclopropyl)methyl]amine
• IUPAC Traditional name: methyl[(2-methylcyclopropyl)methyl]amine
• Synonyms: methyl[(2-methylcyclopropyl)methyl]amine

Database IDs

• MDL Number: MFCD11212402
• PubChem SID: 164328760
• PubChem CID: 43163690

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.3607788
• LogD (pH = 7.4): -2.0245697
• Log P: 0.8747179
• Molar Refractivity: 31.184 cm^3
• Polarizability: 12.598926 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.974

Product Information

• Purity: 95%